| SpectraBase Spectrum ID |
2PQ8AthDvmP |
| Name |
benzoic acid, 4-[3-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-5-oxo-4-[2-oxo-2-[(4-propoxyphenyl)amino]ethyl]-2-thioxo-1-imidazolidinyl]-, ethyl ester |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C36H42ClN5O5S/c1-3-23-47-31-15-11-28(12-16-31)38-33(43)25-32-34(44)42(29-13-9-26(10-14-29)35(45)46-4-2)36(48)41(32)18-6-17-39-19-21-40(22-20-39)30-8-5-7-27(37)24-30/h5,7-16,24,32H,3-4,6,17-23,25H2,1-2H3,(H,38,43) |
| InChIKey |
ONGLMOZUNGQBJU-UHFFFAOYSA-N |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Origin |
1H_CB3_9000_4855 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: NMR/12218246 |
![benzoic acid, 4-[3-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-5-oxo-4-[2-oxo-2-[(4-propoxyphenyl)amino]ethyl]-2-thioxo-1-imidazolidinyl]-, ethyl ester](/api/spectrum/2PQ8AthDvmP/structure.png?h=300&w=458 "benzoic acid, 4-[3-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-5-oxo-4-[2-oxo-2-[(4-propoxyphenyl)amino]ethyl]-2-thioxo-1-imidazolidinyl]-, ethyl ester")
